{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.054063 0.143936 1.020128 ] [ 0.3465957 1.342343 2.730037 ] [ 0.4577023 2.369538 0.7306134 ] [ 2.27069 2.392327 1.674561 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.054063e-10 1.43936e-11 1.020128e-10 ] [ 3.465957e-11 1.342343e-10 2.730037e-10 ] [ 4.577023e-11 2.369538e-10 7.306134e-11 ] [ 2.27069e-10 2.392327e-10 1.674561e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.5893461 0.1422606 -0.2498478 ] [ 0.4175258 0.2010031 1.0394462 ] [ -4.3504915 0.6092184 -3.2309418 ] [ 3.3436196 -0.9524821 2.4413434 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 9.44236542979659e-10 2.279266073809805e-10 -4.003003039183143e-10 ] [ 6.689500753408167e-10 3.220424675283245e-10 1.665376400219401e-09 ] [ -6.970255770289124e-09 9.760754774411829e-10 -5.176539415125469e-09 ] [ 5.357069151968647e-09 -1.526044552350488e-09 3.911463318824383e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -3.1561635193879596 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.056731402185237e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.2071513 0.2735735 0.9856975 ] [ 0.3597985 1.4557476 2.7770501 ] [ 0.2672315 2.3546625 0.6538756 ] [ 2.2948697 2.1641603 1.7387161 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.2071513e-10 2.735735e-11 9.856975e-11 ] [ 3.597985000000001e-11 1.4557476e-10 2.7770501e-10 ] [ 2.672315e-11 2.3546625e-10 6.538756000000001e-11 ] [ 2.2948697e-10 2.1641603e-10 1.7387161e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 4e-07 -6e-07 -2e-07 ] [ -6e-07 -1e-07 1e-06 ] [ -6e-07 7e-07 -7e-07 ] [ 7e-07 0.0 -1e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.408706483200001e-16 -9.6130597248e-16 -3.2043532416e-16 ] [ -9.6130597248e-16 -1.6021766208e-16 1.6021766208e-15 ] [ -9.6130597248e-16 1.12152363456e-15 -1.12152363456e-15 ] [ 1.12152363456e-15 0.0 -1.6021766208e-16 ] ] } "relaxed-potential-energy" { "source-value" -4.056527519387959 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -6.499273553195208e-19 } }